N,N'-bis(3-aminocarbonyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)hexanediamide

Systemtic Name: N,N'-bis(3-aminocarbonyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)hexanediamide Openeye Name: N,N'-bis(3-carbamoyl-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)hexanediamide CAS Name: N,N'-bis(3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)hexanediamide IUPAC Name: N,N'-bis(3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)hexanediamide Traditional Name: N,N'-bis(3-carbamoyl-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)adipamide Formula: C30H42N4O4S2 MolecularWeight: 586.80888

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCCCC(=O)NC3=C(C4=C(S3)CC(CC4)CCC)C(=O)N

Isomeric SMILES

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CCCCC(=O)NC3=C(C4=C(S3)CC(CC4)CCC)C(=O)N

InChI

InChI=1S/C30H42N4O4S2/c1-3-7-17-11-13-19-21(15-17)39-29(25(19)27(31)37)33-23(35)9-5-6-10-24(36)34-30-26(28(32)38)20-14-12-18(8-4-2)16-22(20)40-30/h17-18H,3-16H2,1-2H3,(H2,31,37)(H2,32,38)(H,33,35)(H,34,36)