decanoic acid; 1-[6-(diethylaminomethyl)-6,7,8,9-tetrahydro-5H-carbazol-3-yl]-3-propyl-thiourea

Systemtic Name: decanoic acid; 1-[6-(diethylaminomethyl)-6,7,8,9-tetrahydro-5H-carbazol-3-yl]-3-propyl-thiourea Openeye Name: decanoic acid; 1-[6-(diethylaminomethyl)-6,7,8,9-tetrahydro-5H-carbazol-3-yl]-3-propyl-thiourea CAS Name: decanoic acid; 1-[6-(diethylaminomethyl)-6,7,8,9-tetrahydro-5H-carbazol-3-yl]-3-propylthiourea IUPAC Name: decanoic acid; 1-[6-(diethylaminomethyl)-6,7,8,9-tetrahydro-5H-carbazol-3-yl]-3-propylthiourea Traditional Name: capric acid; 1-[6-(diethylaminomethyl)-6,7,8,9-tetrahydro-5H-carbazol-3-yl]-3-propyl-thiourea Formula: C31H52N4O2S MolecularWeight: 544.83518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)O.CCCNC(=S)NC1=CC2=C(C=C1)NC3=C2CC(CC3)CN(CC)CC

Isomeric SMILES

CCCCCCCCCC(=O)O.CCCNC(=S)NC1=CC2=C(C=C1)NC3=C2CC(CC3)CN(CC)CC

InChI

InChI=1S/C21H32N4S.C10H20O2/c1-4-11-22-21(26)23-16-8-10-20-18(13-16)17-12-15(7-9-19(17)24-20)14-25(5-2)6-3;1-2-3-4-5-6-7-8-9-10(11)12/h8,10,13,15,24H,4-7,9,11-12,14H2,1-3H3,(H2,22,23,26);2-9H2,1H3,(H,11,12)