2-[2-[3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-[3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-[3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-[[3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-[3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-[[4-keto-3-(2-methoxyphenyl)quinazolin-2-yl]thio]acetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C27H26N4O4S2 MolecularWeight: 534.64974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5OC

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5OC

InChI

InChI=1S/C27H26N4O4S2/c1-15-11-12-17-21(13-15)37-25(23(17)24(28)33)30-22(32)14-36-27-29-18-8-4-3-7-16(18)26(34)31(27)19-9-5-6-10-20(19)35-2/h3-10,15H,11-14H2,1-2H3,(H2,28,33)(H,30,32)