N-(1-oxidanylidene-2,3,4,9-tetrahydropyrido[3,4-b]indol-6-yl)-4-pentyl-1-thiophen-2-ylsulfonyl-piperazine-2-carboxamide

Systemtic Name: N-(1-oxidanylidene-2,3,4,9-tetrahydropyrido[3,4-b]indol-6-yl)-4-pentyl-1-thiophen-2-ylsulfonyl-piperazine-2-carboxamide Openeye Name: N-(1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indol-6-yl)-4-pentyl-1-(2-thienylsulfonyl)piperazine-2-carboxamide CAS Name: N-(1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indol-6-yl)-4-pentyl-1-thiophen-2-ylsulfonyl-2-piperazinecarboxamide IUPAC Name: N-(1-oxo-2,3,4,9-tetrahydropyrido[3,4-b]indol-6-yl)-4-pentyl-1-thiophen-2-ylsulfonylpiperazine-2-carboxamide Traditional Name: 4-amyl-N-(1-keto-2,3,4,9-tetrahydro-$b-carbolin-6-yl)-1-(2-thienylsulfonyl)piperazine-2-carboxamide Formula: C25H31N5O4S2 MolecularWeight: 529.67474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCN(C(C1)C(=O)NC2=CC3=C(C=C2)NC4=C3CCNC4=O)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

CCCCCN1CCN(C(C1)C(=O)NC2=CC3=C(C=C2)NC4=C3CCNC4=O)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C25H31N5O4S2/c1-2-3-4-11-29-12-13-30(36(33,34)22-6-5-14-35-22)21(16-29)24(31)27-17-7-8-20-19(15-17)18-9-10-26-25(32)23(18)28-20/h5-8,14-15,21,28H,2-4,9-13,16H2,1H3,(H,26,32)(H,27,31)