1-[2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)ethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-(5-isopropyl-6-methyl-benzofuran-3-yl)acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[2-(6-methyl-5-propan-2-yl-3-benzofuranyl)-1-oxoethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-(6-methyl-5-propan-2-yl-1-benzofuran-3-yl)acetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-(5-isopropyl-6-methyl-benzofuran-3-yl)acetyl]amino]-3-phenyl-thiourea Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC=C2CC(=O)NNC(=S)NC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)OC=C2CC(=O)NNC(=S)NC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C21H23N3O2S/c1-13(2)17-11-18-15(12-26-19(18)9-14(17)3)10-20(25)23-24-21(27)22-16-7-5-4-6-8-16/h4-9,11-13H,10H2,1-3H3,(H,23,25)(H2,22,24,27)