[1-(butylamino)-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indol-4-yl]-(3-propylphenyl)methanethione

Systemtic Name: [1-(butylamino)-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indol-4-yl]-(3-propylphenyl)methanethione Openeye Name: [1-(butylamino)-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indol-4-yl]-(3-propylphenyl)methanethione CAS Name: [1-(butylamino)-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-4-indolyl]-(3-propylphenyl)methanethione IUPAC Name: [1-(butylamino)-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indol-4-yl]-(3-propylphenyl)methanethione Traditional Name: [1-(butylamino)-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)indol-4-yl]-(3-propylphenyl)methanethione Formula: C28H35N3S MolecularWeight: 445.6626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNN1C=C(C2=C(C=CC=C21)C(=S)C3=CC(=CC=C3)CCC)C4=CCN(CC4)C

Isomeric SMILES

CCCCNN1C=C(C2=C(C=CC=C21)C(=S)C3=CC(=CC=C3)CCC)C4=CCN(CC4)C

InChI

InChI=1S/C28H35N3S/c1-4-6-16-29-31-20-25(22-14-17-30(3)18-15-22)27-24(12-8-13-26(27)31)28(32)23-11-7-10-21(19-23)9-5-2/h7-8,10-14,19-20,29H,4-6,9,15-18H2,1-3H3