1-[6-azanyl-1-(3-cyano-1-ethyl-5-methyl-pyrrol-2-yl)-2,4-dimethyl-3-(phenylmethyl)-2H-pyridin-5-yl]-3-ethyl-thiourea

Systemtic Name: 1-[6-azanyl-1-(3-cyano-1-ethyl-5-methyl-pyrrol-2-yl)-2,4-dimethyl-3-(phenylmethyl)-2H-pyridin-5-yl]-3-ethyl-thiourea Openeye Name: 1-[6-amino-3-benzyl-1-(3-cyano-1-ethyl-5-methyl-pyrrol-2-yl)-2,4-dimethyl-2H-pyridin-5-yl]-3-ethyl-thiourea CAS Name: 1-[6-amino-1-(3-cyano-1-ethyl-5-methyl-2-pyrrolyl)-2,4-dimethyl-3-(phenylmethyl)-2H-pyridin-5-yl]-3-ethylthiourea IUPAC Name: 1-[6-amino-3-benzyl-1-(3-cyano-1-ethyl-5-methylpyrrol-2-yl)-2,4-dimethyl-2H-pyridin-5-yl]-3-ethylthiourea Traditional Name: 1-[6-amino-3-benzyl-1-(3-cyano-1-ethyl-5-methyl-pyrrol-2-yl)-2,4-dimethyl-2H-pyridin-5-yl]-3-ethyl-thiourea Formula: C25H32N6S MolecularWeight: 448.62678

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=C(N(C(C(=C1C)CC2=CC=CC=C2)C)C3=C(C=C(N3CC)C)C#N)N

Isomeric SMILES

CCNC(=S)NC1=C(N(C(C(=C1C)CC2=CC=CC=C2)C)C3=C(C=C(N3CC)C)C#N)N

InChI

InChI=1S/C25H32N6S/c1-6-28-25(32)29-22-17(4)21(14-19-11-9-8-10-12-19)18(5)31(23(22)27)24-20(15-26)13-16(3)30(24)7-2/h8-13,18H,6-7,14,27H2,1-5H3,(H2,28,29,32)