1-[3-(4-azanyl-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)propyl]-3-phenethyl-thiourea

Systemtic Name: 1-[3-(4-azanyl-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)propyl]-3-phenethyl-thiourea Openeye Name: 1-[3-(4-amino-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)propyl]-3-phenethyl-thiourea CAS Name: 1-[3-(4-amino-2,6,7-trimethyl-1-imidazo[4,5-c]pyridinyl)propyl]-3-phenethylthiourea IUPAC Name: 1-[3-(4-amino-2,6,7-trimethylimidazo[4,5-c]pyridin-1-yl)propyl]-3-phenethylthiourea Traditional Name: 1-[3-(4-amino-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)propyl]-3-phenethyl-thiourea Formula: C21H28N6S MolecularWeight: 396.55222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(N=C1C)N)N=C(N2CCCNC(=S)NCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C2C(=C(N=C1C)N)N=C(N2CCCNC(=S)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C21H28N6S/c1-14-15(2)25-20(22)18-19(14)27(16(3)26-18)13-7-11-23-21(28)24-12-10-17-8-5-4-6-9-17/h4-6,8-9H,7,10-13H2,1-3H3,(H2,22,25)(H2,23,24,28)