1-(2-diethylaminoethyl)-3-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1-(thiophen-2-ylmethyl)urea

Systemtic Name: 1-(2-diethylaminoethyl)-3-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-1-(thiophen-2-ylmethyl)urea Openeye Name: 1-(2-diethylaminoethyl)-3-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-1-(2-thienylmethyl)urea CAS Name: 1-(2-diethylaminoethyl)-3-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-1-(thiophen-2-ylmethyl)urea IUPAC Name: 1-(2-diethylaminoethyl)-3-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-1-(thiophen-2-ylmethyl)urea Traditional Name: 1-(2-diethylaminoethyl)-3-(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)-1-(2-thenyl)urea Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(CC1=CC=CS1)C(=O)NC2=CC3=C(C=C2)OC(C(=O)N3)C

Isomeric SMILES

CCN(CC)CCN(CC1=CC=CS1)C(=O)NC2=CC3=C(C=C2)OC(C(=O)N3)C

InChI

InChI=1S/C21H28N4O3S/c1-4-24(5-2)10-11-25(14-17-7-6-12-29-17)21(27)22-16-8-9-19-18(13-16)23-20(26)15(3)28-19/h6-9,12-13,15H,4-5,10-11,14H2,1-3H3,(H,22,27)(H,23,26)