3-(2,6-diethylphenyl)-1-(2-dimethylaminoethyl)-1-(1-pyridin-3-ylethyl)thiourea

Systemtic Name: 3-(2,6-diethylphenyl)-1-(2-dimethylaminoethyl)-1-(1-pyridin-3-ylethyl)thiourea Openeye Name: 3-(2,6-diethylphenyl)-1-(2-dimethylaminoethyl)-1-[1-(3-pyridyl)ethyl]thiourea CAS Name: 3-(2,6-diethylphenyl)-1-(2-dimethylaminoethyl)-1-[1-(3-pyridinyl)ethyl]thiourea IUPAC Name: 3-(2,6-diethylphenyl)-1-(2-dimethylaminoethyl)-1-(1-pyridin-3-ylethyl)thiourea Traditional Name: 3-(2,6-diethylphenyl)-1-(2-dimethylaminoethyl)-1-[1-(3-pyridyl)ethyl]thiourea Formula: C22H32N4S MolecularWeight: 384.58128

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N(CCN(C)C)C(C)C2=CN=CC=C2

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N(CCN(C)C)C(C)C2=CN=CC=C2

InChI

InChI=1S/C22H32N4S/c1-6-18-10-8-11-19(7-2)21(18)24-22(27)26(15-14-25(4)5)17(3)20-12-9-13-23-16-20/h8-13,16-17H,6-7,14-15H2,1-5H3,(H,24,27)