N-[(6R)-3-aminocarbonyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[(6R)-3-aminocarbonyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-9H-xanthene-9-carboxamide Openeye Name: N-[(6R)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-9H-xanthene-9-carboxamide CAS Name: N-[(6R)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-9H-xanthene-9-carboxamide IUPAC Name: N-[(6R)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-9H-xanthene-9-carboxamide Traditional Name: N-[(6R)-3-carbamoyl-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-9H-xanthene-9-carboxamide Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CCC[C@@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C26H26N2O3S/c1-2-7-15-12-13-18-21(14-15)32-26(23(18)24(27)29)28-25(30)22-16-8-3-5-10-19(16)31-20-11-6-4-9-17(20)22/h3-6,8-11,15,22H,2,7,12-14H2,1H3,(H2,27,29)(H,28,30)/t15-/m1/s1