2-[4-[3-(thiophen-2-ylmethylcarbamoylamino)phenyl]piperazin-1-yl]ethyl N-(2-ethoxyphenyl)carbamate

Systemtic Name: 2-[4-[3-(thiophen-2-ylmethylcarbamoylamino)phenyl]piperazin-1-yl]ethyl N-(2-ethoxyphenyl)carbamate Openeye Name: 2-[4-[3-(2-thienylmethylcarbamoylamino)phenyl]piperazin-1-yl]ethyl N-(2-ethoxyphenyl)carbamate CAS Name: N-(2-ethoxyphenyl)carbamic acid 2-[4-[3-[[oxo-(thiophen-2-ylmethylamino)methyl]amino]phenyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[3-(thiophen-2-ylmethylcarbamoylamino)phenyl]piperazin-1-yl]ethyl N-(2-ethoxyphenyl)carbamate Traditional Name: N-o-phenetylcarbamic acid 2-[4-[3-(2-thenylcarbamoylamino)phenyl]piperazino]ethyl ester Formula: C27H33N5O4S MolecularWeight: 523.64702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)C3=CC(=CC=C3)NC(=O)NCC4=CC=CS4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)OCCN2CCN(CC2)C3=CC(=CC=C3)NC(=O)NCC4=CC=CS4

InChI

InChI=1S/C27H33N5O4S/c1-2-35-25-11-4-3-10-24(25)30-27(34)36-17-16-31-12-14-32(15-13-31)22-8-5-7-21(19-22)29-26(33)28-20-23-9-6-18-37-23/h3-11,18-19H,2,12-17,20H2,1H3,(H,30,34)(H2,28,29,33)