1-[3-(1-pentylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-(4-phenylphenyl)thiourea

Systemtic Name: 1-[3-(1-pentylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-(4-phenylphenyl)thiourea Openeye Name: 1-[3-(1-pentyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-(4-phenylphenyl)thiourea CAS Name: 1-[3-(1-pentyl-4-piperidinyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-(4-phenylphenyl)thiourea IUPAC Name: 1-[3-(1-pentylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-(4-phenylphenyl)thiourea Traditional Name: 1-[3-(1-amyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-3-(4-phenylphenyl)thiourea Formula: C30H35N5S MolecularWeight: 497.6974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=S)NC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCCN1CCC(CC1)C2=CNC3=C2N=C(C=C3)NC(=S)NC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H35N5S/c1-2-3-7-18-35-19-16-24(17-20-35)26-21-31-27-14-15-28(33-29(26)27)34-30(36)32-25-12-10-23(11-13-25)22-8-5-4-6-9-22/h4-6,8-15,21,24,31H,2-3,7,16-20H2,1H3,(H2,32,33,34,36)