[2-[(2-carbamimidoyl-1-benzothiophen-4-yl)oxy]-2-phenyl-ethyl] N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamate

Systemtic Name: [2-[(2-carbamimidoyl-1-benzothiophen-4-yl)oxy]-2-phenyl-ethyl] N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamate Openeye Name: [2-(2-carbamimidoylbenzothiophen-4-yl)oxy-2-phenyl-ethyl] N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamate CAS Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamic acid [2-[(2-carbamimidoyl-1-benzothiophen-4-yl)oxy]-2-phenylethyl] ester IUPAC Name: [2-[(2-carbamimidoyl-1-benzothiophen-4-yl)oxy]-2-phenylethyl] N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamate Traditional Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamic acid [2-(2-amidinobenzothiophen-4-yl)oxy-2-phenyl-ethyl] ester Formula: C23H23N5O3S MolecularWeight: 449.52542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NC(=O)OCC(C2=CC=CC=C2)OC3=C4C=C(SC4=CC=C3)C(=N)N

Isomeric SMILES

CC1=C(C(=NN1)C)NC(=O)OCC(C2=CC=CC=C2)OC3=C4C=C(SC4=CC=C3)C(=N)N

InChI

InChI=1S/C23H23N5O3S/c1-13-21(14(2)28-27-13)26-23(29)30-12-18(15-7-4-3-5-8-15)31-17-9-6-10-19-16(17)11-20(32-19)22(24)25/h3-11,18H,12H2,1-2H3,(H3,24,25)(H,26,29)(H,27,28)