1-(2,6-diethylphenyl)-3-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea

Systemtic Name: 1-(2,6-diethylphenyl)-3-[1-(phenylmethyl)pyrrolidin-3-yl]thiourea Openeye Name: 1-(1-benzylpyrrolidin-3-yl)-3-(2,6-diethylphenyl)thiourea CAS Name: 1-(2,6-diethylphenyl)-3-[1-(phenylmethyl)-3-pyrrolidinyl]thiourea IUPAC Name: 1-(1-benzylpyrrolidin-3-yl)-3-(2,6-diethylphenyl)thiourea Traditional Name: 1-(1-benzylpyrrolidin-3-yl)-3-(2,6-diethylphenyl)thiourea Formula: C22H29N3S MolecularWeight: 367.55076

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC2CCN(C2)CC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC2CCN(C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3S/c1-3-18-11-8-12-19(4-2)21(18)24-22(26)23-20-13-14-25(16-20)15-17-9-6-5-7-10-17/h5-12,20H,3-4,13-16H2,1-2H3,(H2,23,24,26)